0 B9R0.48 CC(C)CCC(OCC)=O M10189485P [0,0,0,0,0,0|1,0,1]=2 1 B9R0.48 O=C(OCC)CCN(C)C M10164358P [0,0,0,0,0,0|2,0,0]=2 2 B9R0.48 O=C(OCC)\C=C\C(Cl)=O M10193577P [0,0,0,0,0,0|1,0,2]=3 3 B9R0.48 O=C(OCC)\C=C\N(C)C M10027031P [0,0,0,0,0,0|2,0,2]=4 4 B8R0.1 O=C(OCC)CCCBr M10049666P [1,0,0,0,0,0|1,0,1]=3 5 B8R0.1 O=C(OCC)CCCCl M10051695P [1,0,0,0,0,0|1,0,1]=3 6 B8R0.1 O=C(OCC)CCCN M10097497P [1,0,0,0,0,0|1,0,1]=3 7 B8R0.1 O=C(OCC)COCC M10021200P [1,0,0,0,0,0|1,0,1]=3 8 B8R0.1 O=C(OCC)NCCCl M10089881P [1,0,0,0,0,0|2,0,1]=4 9 B8R0.1 O=C(OCC)\C=C\C=O M10049575P [1,0,0,0,0,0|0,0,2]=3 10 B8R0.7 O=C(Cl)OCCOCC M10016994P [1,0,0,0,0,0|2,0,1]=4 11 B8R0.9 CC(CCC(OC)=O)=O M10016714P [1,0,0,0,0,0|0,0,0]=1 12 B8R0.9 O=C(O)CCC(CN)=O M10003359P [1,0,0,0,0,0|2,0,0]=3 13 B8R0.9 O=C(O)\C=C\C(OC)=O M10047363P [1,0,0,0,0,0|1,0,2]=4 14 B8R0.9 O=C(OC)CCC(Cl)=O M10031630P [1,0,0,0,0,0|1,0,0]=2 15 B10R0.26 CN(CC(OCC)=O)C(N)=N M10136398P [0,1,0,0,0,0|3,0,0]=4 16 B10R0.26 O=C(OCC)CN(C)C(N)=N M10136397P [0,1,0,0,0,0|3,0,0]=4 17 B10R0.32 CC(C)CC(C(OCC)=O)=O M10192294P [0,1,0,0,0,0|1,0,2]=4 18 B10R0.78 O=C(O)CNC(CCCC)=O M10182715P [0,1,0,0,0,0|3,0,0]=4 19 B10R1.64 O=C(O)CN1C(CCC1)=O M10273605P [0,0,0,1,0,0|3,0,0]=4 20 B10R1.64 O=C(O)CN1CCNC1=O M10510857P [0,0,0,1,0,0|3,0,0]=4 21 B10R1.113 O=C(C1CC(NCC1)=O)O M10185359P [0,0,0,1,0,0|2,0,0]=3 22 B10R1.140 O=C(C1CC(C1)=O)OCC M10510381P [0,0,0,1,0,0|0,0,0]=1 23 B10R1.140 O=C(C1CC(O)C1)OCC M10147947P [0,0,0,1,0,0|0,0,2]=3 24 B10R1.140 O=C([C@H]1C[C@@H](N)C1)OCC M10089814P [0,0,0,1,0,0|1,0,1]=3 25 B8R0.5 CC(N)CC(OCC)=O M10070569P [0,0,0,0,1,0|1,0,1]=3 26 B8R0.5 C[C@H](O)CC(OCC)=O M10290748P [0,0,0,0,1,0|0,0,2]=3 27 B8R0.5 O=C(OCC)CC(N)=S M10125318P [0,0,0,0,1,0|1,1,0]=3 28 B10R0.3 C=C(C)CCCC(OCC)=O M10239653P [0,0,0,0,0,1|1,0,0]=2 29 B10R0.3 O=C(OCC)CCCC(Cl)=O M10069640P [0,0,0,0,0,1|1,0,0]=2 30 B10R0.3 O=C(OCC)CCNC(C)C M10141409P [0,0,0,0,0,1|1,0,1]=3 31 B7R0.3 O=C(OC)CCC=O M10126962P [2,0,0,0,0,0|0,0,0]=2 32 B7R0.3 O=C(OC)CCCN M10119950P [2,0,0,0,0,0|1,0,1]=4 33 B7R0.7 C=C(OCC)OCC M10046654P [2,0,0,0,0,0|2,0,0]=4 34 B7R0.7 CCCC(OCCl)=O M10221194P [2,0,0,0,0,0|1,0,0]=3 35 B7R0.7 C\C=C\C(OCC)=O M10116065P [2,0,0,0,0,0|0,0,1]=3 36 B7R0.7 O=C(OCC)CCS M10076471P [2,0,0,0,0,0|0,1,0]=3 37 B7R0.7 O=C(OCC)CNN M10098052P [2,0,0,0,0,0|2,0,0]=4 38 B7R0.7 O=C(OCC)\C=C\I M10215517P [2,0,0,0,0,0|1,0,1]=4 39 B7R0.7 O=C(OCCl)OCC M10226366P [2,0,0,0,0,0|2,0,0]=4 40 B7R0.7 O=S(OCC)OCC M10016673P [2,0,0,0,0,0|2,0,0]=4 41 B7R0.4 CC(CCCCBr)=O M10113189P [2,0,0,0,0,0|1,0,1]=4 42 B7R0.4 CC(OCCOC)=O M10003718P [2,0,0,0,0,0|1,0,1]=4 43 B7R0.4 CCCCCC(Cl)=O M10005436P [2,0,0,0,0,0|1,0,1]=4 44 B7R0.4 O=C(Cl)\C=C\OCC M10084811P [2,0,0,0,0,0|1,0,1]=4 45 B7R0.4 O=C(O)CCOCC M10062024P [2,0,0,0,0,0|1,0,0]=3 46 B7R0.6 CC(CCC([O-])=O)=O M10183682P [2,0,0,0,0,0|0,0,1]=3 47 B7R0.6 C[S+](CCC(O)=O)C M10062116P [2,0,0,0,0,0|2,0,0]=4 48 B7R0.6 O=C(C)CCC([O-])=O M10015062P [2,0,0,0,0,0|0,0,1]=3 49 B7R0.6 O=C(O)CCN(C)C M10133339P [2,0,0,0,0,0|2,0,0]=4 50 B7R0.6 O=C([O-])CCC([O-])=O M10041518P [2,0,0,0,0,0|1,0,1]=4 51 B7R0.6 O=C([O-])CCC([O-])=O M10384426P [2,0,0,0,0,0|1,0,1]=4 52 B9R0.5 O=C(OCC)COCCCl M10148096P [1,1,0,0,0,0|1,0,1]=4 53 B9R0.34 O=C(OCC)CC(NC)=O M10443263P [1,1,0,0,0,0|1,0,1]=4 54 B9R0.34 O=C(OCC)CC(O)CCl M10115530P [1,1,0,0,0,0|1,0,1]=4 55 B9R0.35 CCCC(C(O)CCC)=O M10012297P [1,1,0,0,0,0|1,0,1]=4 56 B9R0.35 CCCC(C(OCC)=O)=O M10254180P [1,1,0,0,0,0|0,0,2]=4 57 B9R0.35 O=C(OCC)C(Cl)OCC M10222370P [1,1,0,0,0,0|1,0,1]=4 58 B9R0.2 CC(OCCOCCO)=O M10039891P [1,1,0,0,0,0|1,0,1]=4 59 B9R0.24 O=C(OC)CCC(CN)=O M10475373P [1,1,0,0,0,0|0,0,0]=2 60 B9R0.42 O=C(O)C(CC(OC)=O)=C M10103997P [1,1,0,0,0,0|1,0,1]=4 61 B9R0.6 CC(C(C(OCC)=O)=O)=O M10035324P [0,1,0,0,1,0|0,0,1]=3 62 B9R0.6 CC(C(Cl)C(OCC)=O)=O M10015794P [0,1,0,0,1,0|0,0,0]=2 63 B9R0.6 CC(C(N)C(OCC)=O)=O M10164762P [0,1,0,0,1,0|0,0,0]=2 64 B9R0.6 C[C@@H](O)[C@H](N)C(OCC)=O M10241292P [0,1,0,0,1,0|0,0,2]=4 65 B9R0.44 CC(C)(N)CC(OCC)=O M10502863P [0,1,0,0,1,0|1,0,1]=4 66 B9R0.44 CC(C)(O)CC(OCC)=O M10154399P [0,1,0,0,1,0|0,0,2]=4 67 B11R0.46 CC(CCC(OCCCC)=O)=O M10039525P [0,2,0,0,0,0|0,0,0]=2 68 B11R0.34 O=C(OC(C)(C)C)NCC(C)=O M10799011P [0,2,0,0,0,0|1,0,0]=3 69 B9R1.27 O=C1C(CC)C(CC1)=O M10021371P [1,0,0,1,0,0|1,0,0]=3 70 B9R1.27 O=C1CCC(N1CO)=O M12278742P [1,0,0,1,0,0|2,0,0]=4 71 B9R1.50 O=C1NCCCCCC1 M10018116P [1,0,0,1,0,0|1,0,1]=4 72 B9R1.73 O=C(C1CCC1)OCC M10133979P [1,0,0,1,0,0|0,0,1]=3 73 B9R1.73 O=C(C1CNC1)OCC M10874942P [1,0,0,1,0,0|1,0,0]=3 74 B9R1.6 CC(C1CCCCC1)=O M10021388P [1,0,0,1,0,0|1,0,1]=4 75 B9R1.6 CC(C1CCOCC1)=O M10742643P [1,0,0,1,0,0|0,0,1]=3 76 B9R1.6 O=C(C1CCOCC1)O M10071426P [1,0,0,1,0,0|1,0,1]=4 77 B9R1.6 O=C(Cl)C1CCOCC1 M10241966P [1,0,0,1,0,0|1,0,1]=4 78 B9R1.13 O=C(O)CC1COCC1 M10746626P [1,0,0,1,0,0|1,0,1]=4 79 B9R1.1 O=C1CCC(OC)CC1 M10124180P [1,0,0,1,0,0|1,0,1]=4 80 B9R1.35 O=C(C1CC(CC1)=O)O M10002671P [1,0,0,1,0,0|1,0,0]=3 81 B9R1.35 O=C([C@@H]1CCC(O1)=O)O M10170449P [1,0,0,1,0,0|2,0,0]=4 82 B9R1.35 O=C([C@H]1CCC(O1)=O)O M10271394P [1,0,0,1,0,0|2,0,0]=4 83 B9R1.82 O=C(C1CC(C1)=O)OC M10018683P [1,0,0,1,0,0|0,0,0]=2 84 B9R1.82 O=C(C1CC(Cl)C1)OC M10139679P [1,0,0,1,0,0|1,0,1]=4 85 B9R1.82 O=C(C1CC(O)C1)OC M10067430P [1,0,0,1,0,0|0,0,2]=4 86 B9R1.82 O=C([C@H]1C[C@@H](O)C1)OC M10393173P [1,0,0,1,0,0|0,0,2]=4 87 B9R1.82 O=C([C@H]1C[C@H](O)C1)OC M10393174P [1,0,0,1,0,0|0,0,2]=4 88 B9R1.34 O=C1CC(CC(C)C1)=O M10062153P [0,0,0,1,1,0|1,0,0]=3 89 B9R1.66 O=C1CC(C)(O)CCO1 M12271779P [0,0,0,1,1,0|0,0,2]=4 90 B9R1.137 CC(CC(C1CC1)=O)=O M10170892P [0,0,0,1,1,0|1,0,0]=3 91 B11R1.15 O=C(N1CC(CC1)=O)OCC M10133793P [0,0,0,1,0,1|0,0,0]=2 92 B11R1.20 O=C1CCC(OC(C)C)CC1 M10435461P [0,1,0,1,0,0|1,0,1]=4 93 B11R1.289 O=C(CCN1CCC1)OCC M10110138P [0,1,0,1,0,0|2,0,0]=4 94 B7R0.2 CC(N)CC(OC)=O M10083532P [1,0,0,0,1,0|1,0,1]=4 95 B7R0.2 CC(O)CC(OC)=O M10031579P [1,0,0,0,1,0|0,0,2]=4 96 B7R0.2 C[C@@H](N)CC(OC)=O M10650212P [1,0,0,0,1,0|1,0,1]=4 97 B7R0.2 O=C(OC)C[N+]([O-])=O M10044460P [1,0,0,0,1,0|2,0,0]=4 98 B7R0.5 CC(Br)C(OCC)=O M10013455P [0,0,0,0,2,0|1,0,1]=4 99 B7R0.5 CC(C(CCC)=O)=O M10058081P [0,0,0,0,2,0|1,0,0]=3 100 B7R0.5 CC(S)C(OCC)=O M10162587P [0,0,0,0,2,0|0,1,1]=4 101 B7R0.5 C[C@@H](Cl)C(OCC)=O M10248724P [0,0,0,0,2,0|1,0,1]=4 102 B7R0.5 C[C@@H](O)C(OCC)=O M10109851P [0,0,0,0,2,0|0,0,2]=4 103 B7R0.5 O=C(O)C(OCC)=O M10016281P [0,0,0,0,2,0|1,0,0]=3 104 B7R0.5 O=C(OCC)C(N)=O M10016280P [0,0,0,0,2,0|1,0,0]=3